UCSF

ZINC03861573

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.22 -8.29 -9.03 4 5 0 90 150.13 0

Vendor Notes

Note Type Comments Provided By
Mp [°C] 108 - 112 Acros Organics
PUBCHEM_PATENT_ID EP0063481A1; EP0356965A1; US4464531; WO1998056761A2 IBM Patent Data
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.